| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 19 | Yes |
Popular Name: (2S)-3-[2-dimethylaminoethyl(propyl)amino]-2-(isopropylamino)-2-methyl-propanamide (2S)-3-[2-dimethylaminoethyl(pro…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 0.87 | 3.4 | -93.46 | 5 | 5 | 2 | 67 | 274.453 | 10 | ↓ |
| Hi High (pH 8-9.5) | 0.87 | 1.53 | -34.13 | 4 | 5 | 1 | 63 | 273.445 | 10 | ↓ |
| Hi High (pH 8-9.5) | 0.87 | 3.09 | -114.42 | 5 | 5 | 2 | 67 | 274.453 | 10 | ↓ |
| Hi High (pH 8-9.5) | 0.87 | 4 | -105.41 | 5 | 5 | 2 | 64 | 274.453 | 10 | ↓ |
| Hi High (pH 8-9.5) | 0.87 | 1.24 | -38.66 | 4 | 5 | 1 | 66 | 273.445 | 10 | ↓ |
| Hi High (pH 8-9.5) | 0.87 | 2.54 | -40.42 | 4 | 5 | 1 | 63 | 273.445 | 10 | ↓ |
